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BDBM50261208 (R)-6-(2,6-difluorobenzyl)-2-(2-amino-2-phenylethyl)-4-(3-methoxyphenyl)-1,2,4-triazine-3,5(2H,4H)-dione::CHEMBL494968

SMILES: COc1cccc(c1)-n1c(=O)c(Cc2c(F)cccc2F)nn(C[C@H](N)c2ccccc2)c1=O

InChI Key: InChIKey=ZUSYMUVSTOUTAU-QFIPXVFZSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50261208   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Gonadotropin-releasing hormone receptor


(Homo sapiens (Human))
BDBM50261208
PNG
((R)-6-(2,6-difluorobenzyl)-2-(2-amino-2-phenylethy...)
Show SMILES COc1cccc(c1)-n1c(=O)c(Cc2c(F)cccc2F)nn(C[C@H](N)c2ccccc2)c1=O |r|
Show InChI InChI=1S/C25H22F2N4O3/c1-34-18-10-5-9-17(13-18)31-24(32)23(14-19-20(26)11-6-12-21(19)27)29-30(25(31)33)15-22(28)16-7-3-2-4-8-16/h2-13,22H,14-15,28H2,1H3/t22-/m0/s1
PDB

KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
110n/an/an/an/an/an/an/an/a



Neurocrine Biosciences, Inc

Curated by ChEMBL


Assay Description
Binding affinity at human GnRH receptor


J Med Chem 51: 3331-48 (2008)


Article DOI: 10.1021/jm701249f
BindingDB Entry DOI: 10.7270/Q2KD1XQ0
More data for this
Ligand-Target Pair